Compound Identification
SMILES
OCC(O)C(=O)N1CCC(CC1)C1=C(C(=NN1)C1=CC=C(Cl)C=C1)C1=NC=NC=C1
InChIKey
InChIKey=RAJDYWZOQYCPIT-UHFFFAOYSA-N
Formula
C21H22ClN5O3
Mass
427.89
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Pyrazoles
- Level 5 Phenylpyrazoles
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Subclass
Pyrazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrazoles
Alternative Parents
N-acylpiperidines Chlorobenzenes Pyrimidines and pyrimidine derivatives Monosaccharides Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds 1,2-diols Secondary alcohols Azacyclic compounds Primary alcohols Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpyrazole - N-acyl-piperidine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Monosaccharide - Pyrimidine - Piperidine - Heteroaromatic compound - Tertiary carboxylic acid amide - 1,2-diol - Carboxamide group - Secondary alcohol - Azacycle - Carboxylic acid derivative - Organohalogen compound - Primary alcohol - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.
External Descriptors
Not available